1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone
TL;DR: 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone (CAS 898161-39-2) is a chemical compound with molecular formula C15H19F2NO2 and molecular weight 283.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone
Also Known As: 1-[(2,4-difluorophenoxy)acetyl]azocane, 1-(azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone, 1-azaperhydroocinyl-2-(2,4-difluorophenoxy)ethan-1-one, 1-(1-AZOCANYL)-2-(2,4-DIFLUOROPHENOXY)-1-ETHANONE
| Molecular Formula | C15H19F2NO2 |
|---|---|
| Molecular Weight | 283.14 g/mol |
| LogP | 3.1363 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.1384 |
| Heavy Atoms | 20 |
| Complexity | 457.18677 |
Chemical Identifiers
| CAS Number | 898161-39-2 |
|---|---|
| SMILES | C1CCCN(CCC1)C(=O)COC2=C(C=C(C=C2)F)F |
Product Overview
1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone (CAS 898161-39-2), with molecular formula C15H19F2NO2 and molecular weight 283.14 g/mol. IUPAC: 1-(azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone.
Chemical Property Profile of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone
Property Insights of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone
The XLogP value of 3.1363 indicates that 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone?
The CAS number of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone is 898161-39-2.
What is the molecular formula of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone?
The molecular formula of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone is C15H19F2NO2.
What is the molecular weight of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone?
The molecular weight of 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone is 283.14 g/mol.
Where can I buy 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone?
You can request a quote for 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azocan-1-yl)-2-(2,4-difluorophenoxy)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.